- InChI
- InChI=1S/C20H39NO3/c1-6-10-12-18(8-3)14-21(20(23)16-24-17(5)22)15-19(9-4)13-11-7-2/h18-19H,6-16H2,1-5H3
- InChI Key
- XWBXBJSHUDNSPL-UHFFFAOYSA-N
- Formula
- C20H39NO3
- SMILES
-
CCCCC(CC)CN(CC(CC)CCCC)C(=O)CO
C(C)=O - Molecular Weight1
- 341.53
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.8840 | Relay (1.0) Calculated Property | |
| ΔfG° | -139.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -888.69 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.811 | Crippen Calculated Property | |
| McVol | 311.650 | ml/mol | McGowan Calculated Property |
| Pc | 1100.08 | kPa | Joback Calculated Property |
| Inp | 2150.00 | NIST | |
| Tboil | 611.93 | K | Relay (1.0) Calculated Property |
| Tc | 784.27 | K | Relay (1.0) Calculated Property |
| Tfus | 276.93 | K | Relay (1.0) Calculated Property |
| Vc | 1.132 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [981.56; 1079.23] | J/mol×K | [798.72; 982.42] | 
|
| Cp,gas | 981.56 | J/mol×K | 798.72 | Joback Calculated Property |
| Cp,gas | 1000.36 | J/mol×K | 829.34 | Joback Calculated Property |
| Cp,gas | 1018.11 | J/mol×K | 859.95 | Joback Calculated Property |
| Cp,gas | 1034.83 | J/mol×K | 890.57 | Joback Calculated Property |
| Cp,gas | 1050.58 | J/mol×K | 921.19 | Joback Calculated Property |
| Cp,gas | 1065.37 | J/mol×K | 951.80 | Joback Calculated Property |
| Cp,gas | 1079.23 | J/mol×K | 982.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetoxyacetamide, N,N-bis(2-ethylhexyl)-.
Sources
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